3505-6166 Screening compound: 2-(3-chloro-2-methylphenyl)-4,4-dimethyl-1H,2H,4H,5H-[1,2]thiazolo[5,4-c]quinoline-1-thione

3505-6166 Screening compound: 2-(3-chloro-2-methylphenyl)-4,4-dimethyl-1H,2H,4H,5H-[1,2]thiazolo[5,4-c]quinoline-1-thione
3505-6166 Screening compound: 2-(3-chloro-2-methylphenyl)-4,4-dimethyl-1H,2H,4H,5H-[1,2]thiazolo[5,4-c]quinoline-1-thione alternative view

Chemical Structure Depiction of ChemDiv screening compound 3505-6166
2-(3-chloro-2-methylphenyl)-4,4-dimethyl-1H,2H,4H,5H-[1,2]thiazolo[5,4-c]quinoline-1-thione

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

3505-6166

Molecular Formula

C19H17ClN2S2 (C19 H17 ClN2 S2)

Compound Name

2-(3-chloro-2-methylphenyl)-4,4-dimethyl-1H,2H,4H,5H-[1,2]thiazolo[5,4-c]quinoline-1-thione

IUPAC name

2-(3-chloro-2-methylphenyl)-44-dimethyl-1H2H4H5H-[12]thiazolo[54-c]quinoline-1-thione

SMILES

CC1(C)Nc(cccc2)c2C(C2=S)=C1SN2c1cccc(Cl)c1C

InChI

InChI=1S/C19H17ClN2S2/c1-11-13(20)8-6-10-15(11)22-18(23)16-12-7-4-5-9-14(12)21-19(2,3)17(16)24-22/h4-10,21H,1-3H3

InChI Key

OYOGSIADGHZHLW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01975587

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

372.94

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

5.977

Distribution Coefficient, logD

5.789

Water Solubility, LogSw

-6.24

Polar Surface Area

14.405

Acid Dissociation Constant (pKa)

18.04

Base Dissociation Constant (pKb)

-4.99

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.10

3505-6166 in Drug Discovery

Included in Screening Libraries

KRAS-Targeted Library (16000 compounds)

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases
  • Kinases

References: we are preparing a list of scientific research reports with 3505-6166 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3505-6166?
Check Price and Availability of 3505-6166, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 3505-6166 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3505-6166
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3505-6166
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 3505-6166 available by request